2-methoxyethyl-[[4-(4-methoxyphenyl)-7-oxidanyl-2-oxidanylidene-chromen-8-yl]methyl]azanium chloride

Systemtic Name: 2-methoxyethyl-[[4-(4-methoxyphenyl)-7-oxidanyl-2-oxidanylidene-chromen-8-yl]methyl]azanium chloride Openeye Name: [7-hydroxy-4-(4-methoxyphenyl)-2-oxo-chromen-8-yl]methyl-(2-methoxyethyl)ammonium chloride CAS Name: [7-hydroxy-4-(4-methoxyphenyl)-2-oxo-1-benzopyran-8-yl]methyl-(2-methoxyethyl)ammonium chloride IUPAC Name: [7-hydroxy-4-(4-methoxyphenyl)-2-oxochromen-8-yl]methyl-(2-methoxyethyl)azanium chloride Traditional Name: [7-hydroxy-2-keto-4-(4-methoxyphenyl)chromen-8-yl]methyl-(2-methoxyethyl)ammonium chloride Formula: C20H22ClNO5 MolecularWeight: 391.84538

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH2+]CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=C(C=C3)OC)O.[Cl-]

Isomeric SMILES

COCC[NH2+]CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=C(C=C3)OC)O.[Cl-]

InChI

InChI=1S/C20H21NO5.ClH/c1-24-10-9-21-12-17-18(22)8-7-15-16(11-19(23)26-20(15)17)13-3-5-14(25-2)6-4-13;/h3-8,11,21-22H,9-10,12H2,1-2H3;1H